data_nef_c30380_6bvu save_entry_information _nef_nmr_meta_data.sf_category nef_nmr_meta_data _nef_nmr_meta_data.sf_framecode entry_information _nef_nmr_meta_data.format_name nmr_exchange_format _nef_nmr_meta_data.format_version 1.1 _nef_nmr_meta_data.program_name . _nef_nmr_meta_data.program_version . _nef_nmr_meta_data.creation_date . _nef_nmr_meta_data.uuid . _nef_nmr_meta_data.coordinate_file_name . loop_ _nef_related_entries.database_name _nef_related_entries.database_accession_code PDB 6BVU stop_ save_ save_assembly _nef_molecular_system.sf_category nef_molecular_system _nef_molecular_system.sf_framecode assembly loop_ _nef_covalent_links.chain_code_1 _nef_covalent_links.sequence_code_1 _nef_covalent_links.residue_name_1 _nef_covalent_links.atom_name_1 _nef_covalent_links.chain_code_2 _nef_covalent_links.sequence_code_2 _nef_covalent_links.residue_name_2 _nef_covalent_links.atom_name_2 1 1 CYS SG 1 9 CYS SG 1 10 HIS C 1 11 DPN N 1 11 DPN C 1 12 ARG N 1 14 ARG C 1 1 CYS N stop_ loop_ _nef_sequence.index _nef_sequence.chain_code _nef_sequence.sequence_code _nef_sequence.residue_name _nef_sequence.linking _nef_sequence.residue_variant _nef_sequence.cis_peptide 1 A 1 CYS cyclic -HG,-H2 . 2 A 2 THR middle . . 3 A 3 ALA middle . . 4 A 4 SER middle . . 5 A 5 ILE middle . . 6 A 6 PRO middle . true 7 A 7 PRO middle . false 8 A 8 ILE middle . . 9 A 9 CYS middle -HG . 10 A 10 HIS middle -OXT . 11 A 11 DPN middle -H2,-OXT . 12 A 12 ARG middle -H2 . 13 A 13 TRP middle . . 14 A 14 ARG cyclic -OXT . stop_ save_ save_assigned_chemical_shifts_1 _nef_chemical_shift_list.sf_category nef_chemical_shift_list _nef_chemical_shift_list.sf_framecode assigned_chemical_shifts_1 loop_ _nef_chemical_shift.chain_code _nef_chemical_shift.sequence_code _nef_chemical_shift.residue_name _nef_chemical_shift.atom_name _nef_chemical_shift.element _nef_chemical_shift.isotope_number _nef_chemical_shift.value _nef_chemical_shift.value_uncertainty A 1 CYS H1 H 1 8.535 0.003 A 1 CYS HA H 1 5.156 0.003 A 1 CYS HBy H 1 3.029 0.003 A 1 CYS HBx H 1 2.804 0.005 A 1 CYS CA C 13 56.588 0.000 A 1 CYS CB C 13 46.287 0.027 A 1 CYS N N 15 121.148 0.000 A 2 THR H H 1 8.579 0.002 A 2 THR HA H 1 4.268 0.004 A 2 THR HB H 1 4.410 0.003 A 2 THR HG2% H 1 1.310 0.003 A 2 THR CA C 13 61.827 0.000 A 2 THR CB C 13 70.466 0.000 A 2 THR CG2 C 13 22.169 0.000 A 2 THR N N 15 114.450 0.000 A 3 ALA H H 1 8.393 0.002 A 3 ALA HA H 1 4.446 0.004 A 3 ALA HB% H 1 1.300 0.003 A 3 ALA CA C 13 51.514 0.000 A 3 ALA CB C 13 17.726 0.000 A 3 ALA N N 15 123.905 0.000 A 4 SER H H 1 7.345 0.002 A 4 SER HA H 1 4.313 0.002 A 4 SER HBy H 1 3.797 0.001 A 4 SER HBx H 1 3.680 0.005 A 4 SER CA C 13 59.139 0.000 A 4 SER CB C 13 65.420 0.000 A 4 SER N N 15 113.603 0.000 A 5 ILE H H 1 8.148 0.003 A 5 ILE HA H 1 4.206 0.003 A 5 ILE HB H 1 1.711 0.005 A 5 ILE HD1% H 1 0.755 0.001 A 5 ILE HG1y H 1 1.365 0.004 A 5 ILE HG1x H 1 0.965 0.003 A 5 ILE CA C 13 57.740 0.000 A 5 ILE CB C 13 39.540 0.000 A 5 ILE CD1 C 13 16.903 0.000 A 5 ILE CG1 C 13 26.883 0.000 A 5 ILE N N 15 119.455 0.000 A 6 PRO HA H 1 5.012 0.003 A 6 PRO HBy H 1 2.375 0.004 A 6 PRO HBx H 1 1.944 0.003 A 6 PRO HDy H 1 3.535 0.003 A 6 PRO HDx H 1 3.437 0.004 A 6 PRO HGy H 1 1.870 0.004 A 6 PRO HGx H 1 1.762 0.006 A 6 PRO CA C 13 62.183 0.000 A 6 PRO CB C 13 33.053 0.014 A 6 PRO CD C 13 49.951 0.000 A 6 PRO CG C 13 24.702 0.014 A 7 PRO HA H 1 4.180 0.003 A 7 PRO HBy H 1 2.357 0.004 A 7 PRO HBx H 1 1.780 0.002 A 7 PRO HDy H 1 3.731 0.005 A 7 PRO HDx H 1 3.616 0.003 A 7 PRO HGx H 1 2.035 0.002 A 7 PRO HGy H 1 2.035 0.002 A 7 PRO CA C 13 63.335 0.000 A 7 PRO CB C 13 32.422 0.014 A 7 PRO CD C 13 50.623 0.014 A 7 PRO CG C 13 27.212 0.000 A 8 ILE H H 1 7.836 0.002 A 8 ILE HA H 1 4.192 0.003 A 8 ILE HB H 1 1.848 0.003 A 8 ILE HD1% H 1 0.685 0.003 A 8 ILE HG1y H 1 1.344 0.008 A 8 ILE HG1x H 1 1.041 0.002 A 8 ILE CA C 13 60.428 0.000 A 8 ILE CB C 13 37.921 0.000 A 8 ILE CD1 C 13 17.150 0.000 A 8 ILE CG1 C 13 26.754 0.019 A 8 ILE N N 15 125.291 0.000 A 9 CYS H H 1 8.771 0.001 A 9 CYS HA H 1 4.936 0.003 A 9 CYS HBx H 1 2.876 0.002 A 9 CYS HBy H 1 2.876 0.002 A 9 CYS CA C 13 54.997 0.000 A 9 CYS CB C 13 45.985 0.000 A 9 CYS N N 15 126.122 0.000 A 10 HIS H H 1 8.666 0.003 A 10 HIS HA H 1 4.745 0.004 A 10 HIS HBy H 1 3.148 0.004 A 10 HIS HBx H 1 2.994 0.006 A 10 HIS HD2 H 1 7.082 0.002 A 10 HIS HE1 H 1 8.450 0.000 A 10 HIS CA C 13 66.352 0.000 A 10 HIS CB C 13 29.077 0.000 A 10 HIS N N 15 120.810 0.000 A 11 DPN H H 1 8.458 0.003 A 11 DPN HA H 1 4.316 0.004 A 11 DPN HBy H 1 2.998 0.002 A 11 DPN HBx H 1 2.881 0.005 A 11 DPN HDy H 1 7.118 0.002 A 11 DPN HEy H 1 7.252 0.002 A 11 DPN CA C 13 57.466 0.000 A 11 DPN CB C 13 38.772 0.000 A 11 DPN N N 15 125.044 0.000 A 12 ARG H H 1 7.838 0.003 A 12 ARG HA H 1 3.954 0.004 A 12 ARG HBy H 1 1.264 0.007 A 12 ARG HBx H 1 0.795 0.006 A 12 ARG HDx H 1 2.702 0.003 A 12 ARG HDy H 1 2.702 0.003 A 12 ARG HE H 1 6.820 0.002 A 12 ARG HGy H 1 0.602 0.007 A 12 ARG HGx H 1 0.457 0.002 A 12 ARG CA C 13 55.464 0.000 A 12 ARG CB C 13 29.804 0.014 A 12 ARG CD C 13 42.995 0.000 A 12 ARG CG C 13 26.211 0.014 A 12 ARG N N 15 122.057 0.000 A 12 ARG NE N 15 119.932 0.000 A 13 TRP H H 1 7.911 0.003 A 13 TRP HA H 1 4.640 0.006 A 13 TRP HBy H 1 3.347 0.003 A 13 TRP HBx H 1 3.256 0.004 A 13 TRP HD1 H 1 7.209 0.003 A 13 TRP HE1 H 1 10.079 0.002 A 13 TRP HE3 H 1 7.641 0.002 A 13 TRP HH2 H 1 7.165 0.001 A 13 TRP HZ2 H 1 7.413 0.005 A 13 TRP HZ3 H 1 7.086 0.001 A 13 TRP CA C 13 57.219 0.000 A 13 TRP CB C 13 29.982 0.000 A 13 TRP N N 15 119.870 0.000 A 13 TRP NE1 N 15 129.110 0.000 A 14 ARG H H 1 8.171 0.006 A 14 ARG HA H 1 4.175 0.003 A 14 ARG HBy H 1 1.753 0.005 A 14 ARG HBx H 1 1.646 0.005 A 14 ARG HDx H 1 3.046 0.006 A 14 ARG HDy H 1 3.046 0.006 A 14 ARG HE H 1 7.034 0.004 A 14 ARG HGx H 1 1.491 0.004 A 14 ARG HGy H 1 1.491 0.004 A 14 ARG CA C 13 56.232 0.000 A 14 ARG CB C 13 29.626 0.000 A 14 ARG CD C 13 43.462 0.000 A 14 ARG CG C 13 26.910 0.000 A 14 ARG N N 15 119.870 0.000 A 14 ARG NE N 15 119.762 0.000 stop_ save_ save_CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_2 _nef_distance_restraint_list.restraint_origin noe _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 4 SER HA A 5 ILE H 1.0 0.0 3.11 2 2 A 13 TRP HA A 13 TRP HD1 1.0 0.0 4.39 3 3 A 13 TRP HA A 13 TRP HE3 1.0 0.0 4.30 4 4 A 14 ARG H A 13 TRP HBx 1.0 0.0 4.19 5 5 A 14 ARG H A 13 TRP HBy 1.0 0.0 4.19 6 6 A 14 ARG H A 14 ARG HBx 1.0 0.0 3.93 7 7 A 14 ARG H A 14 ARG HBy 1.0 0.0 3.93 8 8 A 14 ARG H A 14 ARG HGx 1.0 0.0 4.03 9 8 A 14 ARG H A 14 ARG HGy 1.0 0.0 4.03 10 9 A 14 ARG HA A 14 ARG HGx 1.0 0.0 3.83 11 9 A 14 ARG HGy A 14 ARG HA 1.0 0.0 3.83 12 10 A 14 ARG HGy A 14 ARG HBx 1.0 0.0 2.61 13 10 A 14 ARG HBx A 14 ARG HGx 1.0 0.0 2.61 14 11 A 14 ARG HGy A 14 ARG HBy 1.0 0.0 2.61 15 11 A 14 ARG HBy A 14 ARG HGx 1.0 0.0 2.61 16 12 A 5 ILE HA A 5 ILE HD1% 1.0 0.0 3.96 17 13 A 12 ARG H A 12 ARG HGx 1.0 0.0 4.73 18 14 A 12 ARG H A 12 ARG HGy 1.0 0.0 4.73 19 15 A 12 ARG HA A 12 ARG HDx 1.0 0.0 5.22 20 15 A 12 ARG HA A 12 ARG HDy 1.0 0.0 5.22 21 16 A 5 ILE H A 5 ILE HD1% 1.0 0.0 4.84 22 17 A 5 ILE H A 5 ILE HG1y 1.0 0.0 4.82 23 18 A 5 ILE H A 5 ILE HG1x 1.0 0.0 4.82 24 19 A 5 ILE H A 5 ILE HB 1.0 0.0 3.42 25 20 A 14 ARG HA A 1 CYS HA 1.0 0.0 4.76 26 21 A 2 THR H A 2 THR HB 1.0 0.0 3.99 27 22 A 2 THR H A 2 THR HG2% 1.0 0.0 3.34 28 23 A 1 CYS HA A 2 THR H 1.0 0.0 2.79 29 24 A 2 THR HB A 3 ALA H 1.0 0.0 3.18 30 25 A 3 ALA H A 2 THR HA 1.0 0.0 2.86 31 26 A 3 ALA H A 3 ALA HB% 1.0 0.0 3.10 32 27 A 2 THR HG2% A 2 THR HA 1.0 0.0 3.33 33 28 A 3 ALA HA A 4 SER H 1.0 0.0 3.45 34 29 A 2 THR HG2% A 4 SER H 1.0 0.0 4.96 35 30 A 3 ALA HB% A 4 SER H 1.0 0.0 5.12 36 31 A 6 PRO HA A 7 PRO HDx 1.0 0.0 3.24 37 32 A 6 PRO HA A 7 PRO HDy 1.0 0.0 3.24 38 33 A 8 ILE H A 8 ILE HB 1.0 0.0 3.46 39 34 A 8 ILE H A 8 ILE HG1x 1.0 0.0 4.57 40 35 A 8 ILE H A 8 ILE HG1y 1.0 0.0 4.57 41 36 A 8 ILE H A 8 ILE HD1% 1.0 0.0 4.50 42 37 A 8 ILE HA A 8 ILE HG1y 1.0 0.0 4.15 43 38 A 8 ILE HD1% A 8 ILE HA 1.0 0.0 3.46 44 39 A 8 ILE HA A 8 ILE HG1x 1.0 0.0 4.15 45 40 A 8 ILE H A 7 PRO HA 1.0 0.0 2.96 46 41 A 8 ILE H A 7 PRO HBy 1.0 0.0 4.64 47 42 A 8 ILE H A 7 PRO HBx 1.0 0.0 4.64 48 43 A 8 ILE HD1% A 9 CYS H 1.0 0.0 4.81 49 44 A 9 CYS H A 8 ILE HG1y 1.0 0.0 5.50 50 45 A 9 CYS H A 8 ILE HG1x 1.0 0.0 5.50 51 46 A 8 ILE HB A 9 CYS H 1.0 0.0 5.06 52 47 A 8 ILE HA A 9 CYS H 1.0 0.0 2.75 53 48 A 9 CYS H A 9 CYS HBx 1.0 0.0 3.29 54 48 A 9 CYS H A 9 CYS HBy 1.0 0.0 3.29 55 49 A 10 HIS H A 10 HIS HBy 1.0 0.0 3.86 56 50 A 10 HIS H A 10 HIS HBx 1.0 0.0 3.86 57 51 A 10 HIS H A 9 CYS HA 1.0 0.0 2.86 58 52 A 10 HIS H A 9 CYS HBx 1.0 0.0 3.65 59 52 A 9 CYS HBy A 10 HIS H 1.0 0.0 3.65 60 53 A 1 CYS HA A 9 CYS HA 1.0 0.0 3.20 61 54 A 4 SER H A 7 PRO HA 1.0 0.0 4.03 62 55 A 10 HIS HD2 A 14 ARG HBy 1.0 0.0 5.29 63 56 A 10 HIS HD2 A 14 ARG HBx 1.0 0.0 5.29 64 57 A 13 TRP H A 13 TRP HBy 1.0 0.0 3.94 65 58 A 13 TRP H A 13 TRP HBx 1.0 0.0 3.94 66 59 A 2 THR H A 8 ILE H 1.0 0.0 3.77 67 60 A 3 ALA H A 4 SER H 1.0 0.0 4.03 68 61 A 8 ILE H A 9 CYS H 1.0 0.0 5.16 69 62 A 10 HIS H A 13 TRP HBy 1.0 0.0 5.50 70 63 A 10 HIS H A 13 TRP HBx 1.0 0.0 5.50 71 64 A 2 THR H A 9 CYS HA 1.0 0.0 4.24 72 65 A 1 CYS HA A 10 HIS H 1.0 0.0 4.65 73 66 A 2 THR H A 8 ILE HB 1.0 0.0 4.63 74 67 A 2 THR H A 8 ILE HD1% 1.0 0.0 5.50 75 68 A 10 HIS H A 14 ARG HBy 1.0 0.0 5.50 76 69 A 10 HIS H A 14 ARG HBx 1.0 0.0 5.50 77 70 A 13 TRP H A 12 ARG HBx 1.0 0.0 4.73 78 71 A 13 TRP H A 12 ARG HBy 1.0 0.0 4.73 79 72 A 13 TRP H A 12 ARG HGx 1.0 0.0 5.50 80 73 A 13 TRP H A 12 ARG HGy 1.0 0.0 5.50 81 74 A 6 PRO HA A 7 PRO HGx 1.0 0.0 4.94 82 74 A 6 PRO HA A 7 PRO HGy 1.0 0.0 4.94 83 75 A 5 ILE HA A 6 PRO HA 1.0 0.0 2.92 84 76 A 10 HIS H A 13 TRP H 1.0 0.0 5.50 85 77 A 2 THR H A 1 CYS HBy 1.0 0.0 3.84 86 77 A 2 THR H A 1 CYS HBx 1.0 0.0 3.84 87 78 A 2 THR H A 7 PRO HBy 1.0 0.0 5.34 88 78 A 2 THR H A 7 PRO HBx 1.0 0.0 5.34 89 79 A 4 SER H A 4 SER HBy 1.0 0.0 3.65 90 79 A 4 SER H A 4 SER HBx 1.0 0.0 3.65 91 80 A 4 SER H A 7 PRO HBy 1.0 0.0 5.03 92 80 A 4 SER H A 7 PRO HBx 1.0 0.0 5.03 93 81 A 5 ILE H A 4 SER HBy 1.0 0.0 3.26 94 81 A 5 ILE H A 4 SER HBx 1.0 0.0 3.26 95 82 A 5 ILE H A 5 ILE HG1x 1.0 0.0 4.18 96 82 A 5 ILE H A 5 ILE HG1y 1.0 0.0 4.18 97 83 A 5 ILE HA A 6 PRO HBy 1.0 0.0 4.76 98 83 A 5 ILE HA A 6 PRO HBx 1.0 0.0 4.76 99 84 A 6 PRO HA A 7 PRO HDy 1.0 0.0 2.79 100 84 A 6 PRO HA A 7 PRO HDx 1.0 0.0 2.79 101 85 A 6 PRO HBx A 7 PRO HDy 1.0 0.0 3.39 102 85 A 6 PRO HBy A 7 PRO HDy 1.0 0.0 3.39 103 85 A 7 PRO HDx A 6 PRO HBy 1.0 0.0 3.39 104 85 A 6 PRO HBx A 7 PRO HDx 1.0 0.0 3.39 105 86 A 8 ILE H A 7 PRO HBy 1.0 0.0 3.98 106 86 A 8 ILE H A 7 PRO HBx 1.0 0.0 3.98 107 87 A 8 ILE H A 8 ILE HG1x 1.0 0.0 3.91 108 87 A 8 ILE H A 8 ILE HG1y 1.0 0.0 3.91 109 88 A 10 HIS H A 10 HIS HBx 1.0 0.0 3.23 110 88 A 10 HIS H A 10 HIS HBy 1.0 0.0 3.23 111 89 A 10 HIS H A 13 TRP HBx 1.0 0.0 4.68 112 89 A 10 HIS H A 13 TRP HBy 1.0 0.0 4.68 113 90 A 13 TRP H A 10 HIS HBx 1.0 0.0 5.34 114 90 A 13 TRP H A 10 HIS HBy 1.0 0.0 5.34 115 91 A 10 HIS HBy A 13 TRP HBx 1.0 0.0 2.99 116 91 A 10 HIS HBx A 13 TRP HBx 1.0 0.0 2.99 117 91 A 13 TRP HBy A 10 HIS HBx 1.0 0.0 2.99 118 91 A 10 HIS HBy A 13 TRP HBy 1.0 0.0 2.99 119 92 A 10 HIS HD2 A 14 ARG HBy 1.0 0.0 4.48 120 92 A 10 HIS HD2 A 14 ARG HBx 1.0 0.0 4.48 121 93 A 12 ARG H A 12 ARG HBx 1.0 0.0 3.42 122 93 A 12 ARG H A 12 ARG HBy 1.0 0.0 3.42 123 94 A 12 ARG H A 12 ARG HGx 1.0 0.0 3.97 124 94 A 12 ARG H A 12 ARG HGy 1.0 0.0 3.97 125 95 A 12 ARG HBx A 12 ARG HGx 1.0 0.0 2.33 126 95 A 12 ARG HBy A 12 ARG HGx 1.0 0.0 2.33 127 95 A 12 ARG HGy A 12 ARG HBx 1.0 0.0 2.33 128 95 A 12 ARG HBy A 12 ARG HGy 1.0 0.0 2.33 129 96 A 13 TRP H A 13 TRP HBx 1.0 0.0 3.20 130 96 A 13 TRP H A 13 TRP HBy 1.0 0.0 3.20 131 97 A 13 TRP HE3 A 13 TRP HBx 1.0 0.0 3.70 132 97 A 13 TRP HE3 A 13 TRP HBy 1.0 0.0 3.70 133 98 A 14 ARG H A 13 TRP HBx 1.0 0.0 3.42 134 98 A 14 ARG H A 13 TRP HBy 1.0 0.0 3.42 135 99 A 14 ARG H A 14 ARG HBy 1.0 0.0 3.35 136 99 A 14 ARG H A 14 ARG HBx 1.0 0.0 3.35 137 100 A 14 ARG HBx A 14 ARG HGx 1.0 0.0 2.22 138 100 A 14 ARG HBy A 14 ARG HGx 1.0 0.0 2.22 139 100 A 14 ARG HGy A 14 ARG HBy 1.0 0.0 2.22 140 100 A 14 ARG HGy A 14 ARG HBx 1.0 0.0 2.22 stop_ save_ save_CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.sf_category nef_distance_restraint_list _nef_distance_restraint_list.sf_framecode CNS/XPLOR_distance_constraints_4 _nef_distance_restraint_list.restraint_origin hbond _nef_distance_restraint_list.potential_type square-well-parabolic loop_ _nef_distance_restraint.index _nef_distance_restraint.restraint_id _nef_distance_restraint.chain_code_1 _nef_distance_restraint.sequence_code_1 _nef_distance_restraint.residue_name_1 _nef_distance_restraint.atom_name_1 _nef_distance_restraint.chain_code_2 _nef_distance_restraint.sequence_code_2 _nef_distance_restraint.residue_name_2 _nef_distance_restraint.atom_name_2 _nef_distance_restraint.weight _nef_distance_restraint.lower_limit _nef_distance_restraint.upper_limit 1 1 A 2 THR H A 8 ILE O 1.0 0.0 2.3 2 2 A 8 ILE O A 2 THR N 1.0 0.0 3.3 3 3 A 10 HIS H A 14 ARG O 1.0 0.0 2.3 4 4 A 14 ARG O A 10 HIS N 1.0 0.0 3.3 stop_ save_ save_CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.sf_category nef_dihedral_restraint_list _nef_dihedral_restraint_list.sf_framecode CNS/XPLOR_dihedral_3 _nef_dihedral_restraint_list.potential_type square-well-parabolic _nef_dihedral_restraint_list.restraint_origin . loop_ _nef_dihedral_restraint.index _nef_dihedral_restraint.restraint_id _nef_dihedral_restraint.chain_code_1 _nef_dihedral_restraint.sequence_code_1 _nef_dihedral_restraint.residue_name_1 _nef_dihedral_restraint.atom_name_1 _nef_dihedral_restraint.chain_code_2 _nef_dihedral_restraint.sequence_code_2 _nef_dihedral_restraint.residue_name_2 _nef_dihedral_restraint.atom_name_2 _nef_dihedral_restraint.chain_code_3 _nef_dihedral_restraint.sequence_code_3 _nef_dihedral_restraint.residue_name_3 _nef_dihedral_restraint.atom_name_3 _nef_dihedral_restraint.chain_code_4 _nef_dihedral_restraint.sequence_code_4 _nef_dihedral_restraint.residue_name_4 _nef_dihedral_restraint.atom_name_4 _nef_dihedral_restraint.weight _nef_dihedral_restraint.lower_limit _nef_dihedral_restraint.upper_limit _nef_dihedral_restraint.name 1 1 A 8 ILE C A 9 CYS N A 9 CYS CA A 9 CYS C 1.0 -150.0 -90.0 PHI 2 2 A 9 CYS C A 10 HIS N A 10 HIS CA A 10 HIS C 1.0 -150.0 -90.0 PHI 3 3 A 1 CYS C A 2 THR N A 2 THR CA A 2 THR C 1.0 -150.0 -90.0 PHI 4 4 A 12 ARG C A 13 TRP N A 13 TRP CA A 13 TRP C 1.0 -150.0 -90.0 PHI 5 5 A 3 ALA C A 4 SER N A 4 SER CA A 4 SER C 1.0 -103.7 -43.7 PHI 6 6 A 4 SER C A 5 ILE N A 5 ILE CA A 5 ILE C 1.0 -159.0 -65.6 PHI 7 7 A 14 ARG C A 1 CYS N A 1 CYS CA A 1 CYS C 1.0 -150.0 -90.0 . stop_ save_ save_spectral_peak_list_1 _nef_nmr_spectrum.sf_category nef_nmr_spectrum _nef_nmr_spectrum.sf_framecode spectral_peak_list_1 _nef_nmr_spectrum.experiment_classification . _nef_nmr_spectrum.experiment_type . _nef_nmr_spectrum.num_dimensions 3 _nef_nmr_spectrum.chemical_shift_list . loop_ _nef_spectrum_dimension.dimension_id _nef_spectrum_dimension.axis_unit _nef_spectrum_dimension.axis_code _nef_spectrum_dimension.spectrometer_frequency _nef_spectrum_dimension.spectral_width _nef_spectrum_dimension.value_first_point _nef_spectrum_dimension.folding _nef_spectrum_dimension.absolute_peak_positions _nef_spectrum_dimension.is_acquisition 2 ppm . . 100.00 . . . . 2 ppm . . 35.00 . . . . 2 ppm . . 11.9705 . . . . stop_ save_